1-Isobutyl-3-phenylurea
Basic information
- CAS
15054-53-2- Standard SMILES
CC(C)CNC(=O)Nc1ccccc1- InChIKey
IKHKMGSVONNVKU-UHFFFAOYSA-N- Molecular formula
- C11H16N2O
- Average molar mass
- 192.26 g/mol
- Monoisotopic mass
- 192.12626314
Names & identifiers
- Preferred name
- 1-Isobutyl-3-phenylurea
- IUPAC
- 1-(2-methylpropyl)-3-phenylurea
- English name
- 1-Isobutyl-3-phenylurea
- Molecular formula
- C11H16N2O
- Molecular weight
- 192.26
Names & synonyms
1-Isobutyl-3-phenylureaRefChem:433296667-396-01-(2-methylpropyl)-3-phenylurea15054-53-2[(2-methylpropyl)amino]-N-benzamideNSC136967SCHEMBL8668377SCHEMBL10596294DTXSID50300426IKHKMGSVONNVKU-UHFFFAOYSA-NN-(2-Methylpropyl)-N'-phenylurea
Show more names
Urea, N-(2-methylpropyl)-N'-phenyl-
SBB056570AKOS001298123NSC-136967ST50550294Z44603417
Database identifiers
- CAS
15054-53-2- PubChem CID
- 282872
- DTXSID
DTXSID50300426- EC Number
- 667-396-0
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 41.1 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 3
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 174
Physicochemical properties
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302
- Precautionary statements
- 264 · P264-P270-P301+P312-P330-P501
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P264, P270, P301+P317, P330, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 38 reports by companies from 1 notifications to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302
- Precautionary statements
- P264-P270-P301+P312-P330-P501
Suppliers
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Related reactions
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Compound notes
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